ChemSpider 2D Image | 4-(4-Butoxybenzoyl)-1-[3-(diethylamino)propyl]-3-hydroxy-5-(3-phenoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one | C34H40N2O5

4-(4-Butoxybenzoyl)-1-[3-(diethylamino)propyl]-3-hydroxy-5-(3-phenoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC34H40N2O5
  • Average mass556.692 Da
  • Monoisotopic mass556.293701 Da
  • ChemSpider ID11969024

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2H-Pyrrol-2-one, 4-(4-butoxybenzoyl)-1-[3-(diethylamino)propyl]-1,5-dihydro-3-hydroxy-5-(3-phenoxyphenyl)- [ACD/Index Name]
4-(4-Butoxybenzoyl)-1-[3-(diethylamino)propyl]-3-hydroxy-5-(3-phenoxyphenyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
4-(4-Butoxybenzoyl)-1-[3-(diethylamino)propyl]-3-hydroxy-5-(3-phenoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
4-(4-Butoxybenzoyl)-1-[3-(diéthylamino)propyl]-3-hydroxy-5-(3-phénoxyphényl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
1-[3-(diethylamino)propyl]-4-[(4-butoxyphenyl)carbonyl]-3-hydroxy-5-(3-phenoxyphenyl)-3-pyrrolin-2-one
4-(4-butoxybenzoyl)-1-(3-(diethylamino)propyl)-3-hydroxy-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one
4-(4-butoxybenzoyl)-1-[3-(diethylamino)propyl]-3-hydroxy-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one
4-[(4-butoxyphenyl)carbonyl]-1-[3-(diethylamino)propyl]-3-hydroxy-5-(3-phenoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
617695-70-2 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 708.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.8±3.0 kJ/mol
Flash Point: 382.4±32.9 °C
Index of Refraction: 1.591
Molar Refractivity: 160.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 29.73
ACD/KOC (pH 5.5): 75.32
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 31.83
ACD/KOC (pH 7.4): 80.65
Polar Surface Area: 79 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 475.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement